S-[[5-(1-hydroxyethyl)-2-methoxy-6-methyl-pyridin-3-yl]amino] 4-(3,5-dimethoxyphenyl)piperazine-1-carbothioate

Systemtic Name: S-[[5-(1-hydroxyethyl)-2-methoxy-6-methyl-pyridin-3-yl]amino] 4-(3,5-dimethoxyphenyl)piperazine-1-carbothioate Openeye Name: S-[[5-(1-hydroxyethyl)-2-methoxy-6-methyl-3-pyridyl]amino] 4-(3,5-dimethoxyphenyl)piperazine-1-carbothioate CAS Name: 4-(3,5-dimethoxyphenyl)-1-piperazinecarbothioic acid S-[[5-(1-hydroxyethyl)-2-methoxy-6-methyl-3-pyridinyl]amino] ester IUPAC Name: S-[[5-(1-hydroxyethyl)-2-methoxy-6-methylpyridin-3-yl]amino] 4-(3,5-dimethoxyphenyl)piperazine-1-carbothioate Traditional Name: 4-(3,5-dimethoxyphenyl)piperazine-1-carbothioic acid S-[[5-(1-hydroxyethyl)-2-methoxy-6-methyl-3-pyridyl]amino] ester Formula: C22H30N4O5S MolecularWeight: 462.5624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1C(C)O)NSC(=O)N2CCN(CC2)C3=CC(=CC(=C3)OC)OC)OC

Isomeric SMILES

CC1=NC(=C(C=C1C(C)O)NSC(=O)N2CCN(CC2)C3=CC(=CC(=C3)OC)OC)OC

InChI

InChI=1S/C22H30N4O5S/c1-14-19(15(2)27)13-20(21(23-14)31-5)24-32-22(28)26-8-6-25(7-9-26)16-10-17(29-3)12-18(11-16)30-4/h10-13,15,24,27H,6-9H2,1-5H3